3-[(3-oxidanidyl-3-oxidanylidene-propyl)-(phenylsulfonyl)amino]propanoate

Systemtic Name: 3-[(3-oxidanidyl-3-oxidanylidene-propyl)-(phenylsulfonyl)amino]propanoate Openeye Name: 3-[benzenesulfonyl-(3-oxido-3-oxo-propyl)amino]propanoate CAS Name: 3-[benzenesulfonyl-(3-oxido-3-oxopropyl)amino]propanoate IUPAC Name: 3-[benzenesulfonyl-(3-oxido-3-oxopropyl)amino]propanoate Traditional Name: 3-[besyl-(3-keto-3-oxido-propyl)amino]propionate Formula: C12H13NO6S-2 MolecularWeight: 299.29972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)[O-])CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)[O-])CCC(=O)[O-]

InChI

InChI=1S/C12H15NO6S/c14-11(15)6-8-13(9-7-12(16)17)20(18,19)10-4-2-1-3-5-10/h1-5H,6-9H2,(H,14,15)(H,16,17)/p-2